SCHEMBL8344420

SCHEMBL8344420

CCCCCC(CNC(=O)Nc1c(SC)cc(C)nc1SC)c1cc(OC)ccc1OC

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADRA1A P35348 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ SOAT1 P35610 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8340821 0.99 KMT2A (0.36) KMT2ALMNACYP1A2TSHRCYP2C19
SCHEMBL8340844 0.88 SOAT1 (0.36) SOAT1PKMHSD17B10
SCHEMBL8344037 0.87 SOAT1 (0.34) ALDH1A1SOAT1
SCHEMBL8338876 0.85 SOAT1 (0.35) SOAT1PKMHSD17B10
SCHEMBL9211015 0.84 GAA (0.35) SOAT1
SCHEMBL8338705 0.84 SOAT1 (0.37) ALDH1A1SOAT1MAPT
SCHEMBL8338150 0.83 SOAT1 (0.37) ALDH1A1SOAT1MAPT
SCHEMBL8344880 0.83 SOAT1 (0.37) ALDH1A1SOAT1MAPT
SCHEMBL8345179 0.83 SOAT1 (0.41) SOAT1
SCHEMBL8338866 0.82 SOAT1 (0.41) KMT2AMEN1ALDH1A1SOAT1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6001860-A N-aryl and N-heteroarylurea derivatives as inhibitors of acyl coenzyme A: Cholesterol acyl transferase (ACAT) PFIZER INC. (US) 1999-12-14 — — US claimed
WO-1993024458-A1 NEW N-ARYL AND N-HETEROARYLUREA DERIVATIVES AS INHIBITORS OF ACYL COENZYME A:CHOLESTEROL ACYL TRANSFERASE (ACAT) PFIZER INC. (US) 1993-12-09 — — WO claimed
US-6001860-A N-aryl and N-heteroarylurea derivatives as inhibitors of acyl coenzyme A: Cholesterol acyl transferase (ACAT) PFIZER INC. (US) 1999-12-14 — — US disclosed
WO-1993024458-A1 NEW N-ARYL AND N-HETEROARYLUREA DERIVATIVES AS INHIBITORS OF ACYL COENZYME A:CHOLESTEROL ACYL TRANSFERASE (ACAT) PFIZER INC. (US) 1993-12-09 — — WO disclosed
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